spiramycin
TL;DR: spiramycin (CAS 679439-18-0) is a chemical compound with molecular formula C43H74N2O14 and molecular weight 842.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
Also Known As: spiramycin, Spiramycin base, Spiramycinum, Espiramicin, Provamycin
| Molecular Formula | C43H74N2O14 |
|---|---|
| Molecular Weight | 842.51 g/mol |
| LogP | 2.3251 |
| Topological Polar Surface Area | 195.38 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Exact Mass | 842.514 |
| Heavy Atoms | 59 |
| Complexity | 1365.2148 |
Chemical Identifiers
| CAS Number | 679439-18-0 |
|---|---|
| SMILES | C[C@@H]1C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)O)(C)O)N(C)C)O)CC=O)C)OC4CCC(C(O4)C)N(C)C |
Product Overview
spiramycin (CAS 679439-18-0), with molecular formula C43H74N2O14 and molecular weight 842.51 g/mol. IUPAC: 2-[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde.
Chemical Property Profile of spiramycin
Property Insights of spiramycin
The XLogP value of 2.3251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for spiramycin. The TPSA of 195.38 Ų indicates high polarity, suggesting spiramycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, spiramycin has 4 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of spiramycin?
The CAS number of spiramycin is 679439-18-0.
What is the molecular formula of spiramycin?
The molecular formula of spiramycin is C43H74N2O14.
What is the molecular weight of spiramycin?
The molecular weight of spiramycin is 842.51 g/mol.
Where can I buy spiramycin?
You can request a quote for spiramycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for spiramycin?
Yes, KEHONG BIO provides custom synthesis services for spiramycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.